For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1,2-bis[4-(bromomethyl)phenyl]perhydro-3,7-diazepinedione
SpectraBase Compound ID 7d6pCe8Bvyf
InChI InChI=1S/C19H18Br2N2O2/c20-9-12-1-5-14(6-2-12)17-18(23-19(25)16(24)11-22-17)15-7-3-13(10-21)4-8-15/h1-8,17-18,22H,9-11H2,(H,23,25)
InChIKey VUZHDRQKCBOMMJ-UHFFFAOYSA-N
Mol Weight 466.17 g/mol
Molecular Formula C19H18Br2N2O2
Exact Mass 463.973504 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HLv41geXP8
Name 1,2-bis[4-(bromomethyl)phenyl]perhydro-3,7-diazepinedione
CAS Registry Number 121014-16-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18Br2N2O2
InChI InChI=1S/C19H18Br2N2O2/c20-9-12-1-5-14(6-2-12)17-18(23-19(25)16(24)11-22-17)15-7-3-13(10-21)4-8-15/h1-8,17-18,22H,9-11H2,(H,23,25)
InChIKey VUZHDRQKCBOMMJ-UHFFFAOYSA-N
Molecular Weight 466.173 g/mol
SMILES N1C(C(NCC(C1=O)=O)c1ccc(cc1)CBr)c1ccc(cc1)CBr
SPLASH splash10-0a4r-0935100000-02fdc146e6a47303567f
Source of Spectrum K-122-1507-9
Wiley ID 1391389